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	hartrees
Energy at 0K	-93.440369
Energy at 298.15K	-93.440468
HF Energy	-93.440369
Nuclear repulsion energy	23.826768

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	Σ	3368	3358	51.12	30.16	0.24	0.39
2	Σ	2113	2107	0.14	44.63	0.15	0.26
3	Π	725	723	36.90	0.16	0.75	0.86
3	Π	725	723	36.90	0.16	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.502
H2	0.000	0.000	-1.574
N3	0.000	0.000	0.655

	C1	H2	N3
C1		1.0713	1.1575
H2	1.0713		2.2288
N3	1.1575	2.2288

Number	Element	Mulliken
1	C	-0.086
2	H	0.132
3	N	-0.046

All results from a given calculation for HCN (Hydrogen cyanide)

using model chemistry: BLYP/cc-pVTZ

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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<r²>	13.948
(<r²>)^1/2	3.735